Computed Properties of C7H6Cl2On June 1, 2021, Sui, Yan-Fei; Ansari, Mohammad Fawad; Zhou, Cheng-He published an article in Chemistry – An Asian Journal. The article was 《Pyrimidinetrione-imidazoles as a Unique Structural Type of Potential Agents towards Candida Albicans: Design, Synthesis and Biological Evaluation》. The article mentions the following:
A series of pyrimidinetrione-imidazole conjugates I [R1 = H, Et, 2-chlorobenzl, etc.] as potentially antifungal agents were developed. Bioassays manifested that I [R1 = 4-fluorobenzl] exerted favorable inhibition towards C. albicans (MIC=0.002 mM), being 6.5 folds more active than clin. antifungal drug fluconazole (MIC=0.013 mM). Preliminary mechanism research indicated that compound I [R1 = 4-fluorobenzl] could not only depolarize membrane potential but also permeabilize the membrane of C. albicans. Mol. docking was operated to simulate the interaction mode between mol. I [R1 = 4-fluorobenzl] and CYP51. In addition, hybrid I [R1 = 4-fluorobenzl] might form I [R1 = 4-fluorobenzl]-DNA supramol. complex via intercalating into DNA. The interference of membrane and DNA might contributed to its fungicidal capacity with no obvious tendency to induce the resistance against C. albicans. Conjugate I [R1 = 4-fluorobenzl] endowed good blood compatibility as well as low cytotoxicity towards HeLa and HEK-293T cells. In addition to this study using 3-Chlorobenzylchloride, there are many other studies that have used 3-Chlorobenzylchloride(cas: 620-20-2Computed Properties of C7H6Cl2) was used in this study.
3-Chlorobenzylchloride(cas: 620-20-2) has been used in the reaction of 3-methoxybenzyl chloride and ethyl 4-bromobenzoate in pure water, using zinc dust and a Pd catalyst.Computed Properties of C7H6Cl2
Referemce:
Chloride – Wikipedia,
Chlorides – an overview | ScienceDirect Topics